| Wednesday, October 24, 2007: 1:55 PM-5:00 PM | |||
| Redbud A (Greenville Hyatt Regency Hotel) | |||
| Analytical, Environmental and Physical Chemistry (9) | |||
| Modeling of Covalent Bonding Interactions I | |||
| Sponsor: | ACS Division of Physical Chemistry | ||
| Presider: | Steven J. Stuart | ||
| Organizers: | Steven J. Stuart D. W. Brenner | ||
| 1:55 PM | Welcoming Remarks | ||
| 2:00 PM | 44 | Addressing Practical Issues in Developing a Reactive Empirical Bond Order Potential: A Transferable Potential for N-H Species Yanhong Hu, D. W. Brenner | |
| 2:40 PM | 45 | Recent Advances in Bond-Order Potential Development Tao Liang, Boris Ni, SeongJun Heo, Wen-Dung Hsu, Tzu-Ray Shan, Simon Phillpot, Susan Sinnott | |
| 3:20 PM | Break | ||
| 3:40 PM | 46 | Development and Application of Angular-Dependent Embedded Atom Method Potential for Atomistic Modeling of Metal-Si/Ge Systems Avinash M. Dongare, Matthew Neurock, Leonid V. Zhigilei | |
| 4:20 PM | 47 | Development of a ReaxFF Potential for Simulating Chemistry in the Aqueous Phase Adri C.T. Van Duin, Vyacheslav Bryantsev, Bill Goddard | |
Back to The Southeastern Regional Meeting (October 24 – 27, 2007)